SCHEMBL7540309

SCHEMBL7540309

CCCCC(CC)COC(=O)C1CCC2OC2C1C(=O)OCC(CC)CCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.45
TSHR P16473 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 1/20 0.45
ALDH1A1 P00352 4/20 0.40
CA2 P00918 1/20 0.40
RECQL P46063 1/20 0.39
LMNA P02545 2/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP14 P50281 1/20 0.38
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PPM1B O75688 2/20 0.36
PTPN1 P18031 2/20 0.36
PPP1CC P36873 2/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2272253 0.83 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL1297449 0.82 CYP3A4 (0.51) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL1297731 0.81 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL28498797 0.80 PPM1B (0.49) TSHRATMALDH1A1LMNAPPM1B
SCHEMBL1196591 0.80 CYP3A4 (0.47) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL4777385 0.79 CYP3A4 (0.54) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL14874506 0.79 CYP3A4 (0.57) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL14874505 0.79 CYP3A4 (0.57) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL2375699 0.79 CYP3A4 (0.48) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL1297705 0.79 CYP3A4 (0.48) CYP3A4TSHRTDP1ATMALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018115-B2 Polyurethane gel material, polyurethane gel, pseudo-biomaterial, and producing method of polyurethane gel MITSUI CHEMICALS, INC. (JP) 2024-06-25 US disclosed
CN-111936541-B Polyurethane gel material, polyurethane gel, biomimetic material and manufacturing method of polyurethane gel 三井化学株式会社 2022-08-02 CN disclosed
US-20210139636-A1 POLYURETHANE GEL MATERIAL, POLYURETHANE GEL, PSEUDO-BIOMATERIAL, AND PRODUCING METHOD OF POLYURETHANE GEL MITSUI CHEMICALS, INC. (JP) 2021-05-13 US disclosed
US-20210139639-A1 POLYURETHANE GEL MATERIAL, POLYURETHANE GEL, PSEUDO-BIOMATERIAL, AND PRODUCING METHOD OF POLYURETHANE GEL MITSUI CHEMICALS, INC. (JP) 2021-05-13 US disclosed
EP-3778690-A1 POLYURETHANE GEL MATERIAL, POLYURETHANE GEL, PSEUDO-BIOLOGICAL MATERIAL, AND PRODUCTION METHOD FOR POLYURETHANE GEL Mitsui Chemicals, Inc. (JP) 2021-02-17 EP disclosed
EP-3778689-A1 POLYURETHANE GEL MATERIAL, POLYURETHANE GEL, PSEUDO-BIOLOGICAL MATERIAL, AND PRODUCTION METHOD FOR POLYURETHANE GEL Mitsui Chemicals, Inc. (JP) 2021-02-17 EP disclosed
CN-111936541-A Polyurethane gel material, polyurethane gel, biomimetic material and manufacturing method of polyurethane gel 三井化学株式会社 2020-11-13 CN disclosed
CN-111902451-A Polyurethane gel material, polyurethane gel, biomimetic material and manufacturing method of polyurethane gel 三井化学株式会社 2020-11-06 CN disclosed
US-20020198352-A1 Curable composition ASAHI GLASS COMPANY, LIMITED (JP) 2002-12-26 US disclosed
EP-1264854-A1 Curable composition ASAHI GLASS COMPANY LTD. (JP) 2002-12-11 EP disclosed